太赫兹电场增强碳纳米管脱盐性能

IF 5.5 3区 材料科学 Q1 ELECTROCHEMISTRY
Yue Wu , Zi Wang , Tao Zhang , Shuang Li , Yunzhen Zhao , Jiaye Su
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引用次数: 0

摘要

在海水淡化过程中,获得高的盐溶液截止率,同时确保显著的水通量通过膜是至关重要的。在此,我们通过分子动力学(MD)模拟证明,施加太赫兹电场可以大大提高碳纳米管(CNTs)的脱盐性能。在一定场频下,随着场强的增大,Cl−、Na+和水的通量均呈减小趋势;然而,在模拟时间内,离子抑制率显著提高,达到100%。此外,在给定场强下,随着场频的增加,Cl−、Na+和水的通量表现出最小的行为,导致离子排斥行为最大(高达100%)。这表明对脱盐性能进行频率优化,其中最佳离子抑制发生在10 ~ 20太赫兹的频率范围内。因此,利用横向太赫兹电场在海水淡化中具有很大的前景,为设计低能耗和高淡水生产效率的海水淡化膜提供了有价值的见解。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Enhanced desalination performance in carbon nanotubes by terahertz electric fields
Attaining a high cut-off rate for salt solutions while ensuring significant water flux across membranes is crucial in the desalination process. Herein, we demonstrate by molecular dynamics (MD) simulations that the desalination performance in carbon nanotubes (CNTs) can be greatly improved by applying a terahertz electric field. At a specific field frequency, with increasing the field strength, the fluxes of Cl, Na+ and water collectively exhibit a decreasing trend; however, the ion rejection demonstrates a significant increase, reaching up to 100 % within the simulation time. Moreover, for a given field strength, the fluxes of Cl, Na+, and water display a minimum behavior as the field frequency increases, leading to the maximum behavior of ion rejection (up to 100 %). This suggests a frequency optimization for the desalination performance, where the best ion rejection occurs in a frequency range of 10 ∼ 20 THz. Consequently, the utilization of lateral terahertz electric field holds great promise in desalination, providing valuable insights for designing desalination membranes with low energy consumption and high freshwater production efficiency.
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来源期刊
Electrochimica Acta
Electrochimica Acta 工程技术-电化学
CiteScore
11.30
自引率
6.10%
发文量
1634
审稿时长
41 days
期刊介绍: Electrochimica Acta is an international journal. It is intended for the publication of both original work and reviews in the field of electrochemistry. Electrochemistry should be interpreted to mean any of the research fields covered by the Divisions of the International Society of Electrochemistry listed below, as well as emerging scientific domains covered by ISE New Topics Committee.
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